SCHEMBL3977045

SCHEMBL3977045

CCC=CCC(N)=O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11937917 1.00
SCHEMBL3977043 1.00
SCHEMBL21090078 0.93 ALDH1A1 (0.50)
SCHEMBL1899759 0.85 ALDH1A1 (0.47)
SCHEMBL14842937 0.85 ALDH1A1 (0.47)
SCHEMBL13784843 0.84 TRPA1 (0.42)
Ethylene SCHEMBL11644945 0.79 ALDH1A1 (0.42)
Carbamic Acid SCHEMBL28862996 0.79 ALDH1A1 (0.48)
Carbamic Acid SCHEMBL28337520 0.79 ALDH1A1 (0.48)
Carbamic Acid SCHEMBL28129659 0.79 ALDH1A1 (0.48)

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12037463-B2 Antimicrobial ophthalmic devices comprising polysiloxane-polyglycerol block copolymers and methods of making and use thereof Clearlab Sg Pte Ltd. (SG) 2024-07-16 US disclosed
US-20230227613-A1 ANTIMICROBIAL OPHTHALMIC DEVICES COMPRISING POLYSILOXANE-POLYGLYCEROL BLOCK COPOLYMERS AND METHODS OF MAKING AND USE THEREOF CLEARLAB SG PTE LTD (SG) 2023-07-20 US disclosed
US-20230212357-A1 WOUND DRESSINGS COMPRISING POLYSILOXANE-POLYGLYCEROL BLOCK COPOLYMERS AND METHODS OF MAKING AND USE THEREOF CLEARLAB SG PTE LTD (SG) 2023-07-06 US disclosed
US-11649325-B2 Actinically-crosslinkable polysiloxane-polyglycerol block copolymers and methods of making and use thereof Clearlab Sg Pte Ltd. (SG) 2023-05-16 US disclosed
US-20170291870-A1 SURFACTANT-CONTAINING AMIDE COMPOUND SOLUTION MITSUBISHI RAYON CO., LTD. (JP) 2017-10-12 US disclosed
EP-2056798-A2 SORBIC ACID ANALOG CO-CRYSTALS Amgen, Inc (US) 2009-05-13 EP disclosed
WO-2008024437-A2 SORBIC ACID ANALOG CO-CRYSTALS AMGEN INC. (US) 2008-02-28 WO disclosed
US-20080051453-A1 Sorbic acid analog co-crystals AMGEN INC. 2008-02-28 US disclosed
US-3984478-A TREATING AN UNSATURATED COMPOUND WITH CARBON MONOXIDE IN A HETEROGENEOUS CATALYST UNIVERSAL OIL PRODUCTS COMPANY (US) 1976-10-05 US disclosed